| SpectraBase Compound ID | GumMS9xsnqq |
|---|---|
| InChI | InChI=1S/C14H15Br/c1-2-3-4-5-6-7-8-13-9-11-14(15)12-10-13/h5-6,9-12H,2-4H2,1H3/b6-5- |
| InChIKey | ZAFWIKWHCWZHNE-WAYWQWQTSA-N |
| Mol Weight | 263.18 g/mol |
| Molecular Formula | C14H15Br |
| Exact Mass | 262.035713 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DqKTo6LXG1n |
|---|---|
| Name | (Z)-1-(4-Bromophenyl)oct-3-en-1-yne |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 262.035713483 u |
| Formula | C14H15Br |
| InChI | InChI=1S/C14H15Br/c1-2-3-4-5-6-7-8-13-9-11-14(15)12-10-13/h5-6,9-12H,2-4H2,1H3/b6-5- |
| InChIKey | ZAFWIKWHCWZHNE-WAYWQWQTSA-N |
| Molecular Weight | 263.178 g/mol |
| SMILES | C(#CC1=CC=C(C=C1)Br)\C=C/CCCC |